0 mol 8 unq 0 iso 0 dist 8.4444 7.20987 5.00267 13.6972 6.32152 7.3915 12.3805 10.715 7.43529 8.96553 numMergedOcc 0
1 mol 19 unq 0 iso 0 dist 8.75332 4.93362 7.69625 10.1953 10.3648 6.92532 15.6111 17.4261 12.3486 7.20519 numMergedOcc 0
2 mol 19 unq 1 iso 0 dist 8.75332 4.93362 7.69625 10.1953 10.3648 6.92532 9.01721 11.6624 5.18512 4.54938 numMergedOcc 0
3 mol 19 unq 2 iso 0 dist 8.75332 4.93362 7.69625 10.1953 10.3648 6.92532 14.1708 13.8921 9.47529 6.864 numMergedOcc 0
4 mol 19 unq 3 iso 0 dist 8.75332 4.93362 7.69625 7.84393 6.49317 6.36455 9.01721 11.6624 5.18512 7.82074 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 4.61828 13.674 9.38831 10.4452 5.97304 6.72502 9.20254 6.60423 6.58998 8.86116 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 4.61828 13.674 9.38831 10.4452 5.97304 6.72502 12.3729 9.0934 6.59374 8.38394 numMergedOcc 0
7 mol 115 unq 0 iso 0 dist 8.99731 4.64486 8.71286 9.56867 7.3094 5.74857 9.97256 10.9734 6.08806 6.11741 numMergedOcc 0
8 mol 115 unq 1 iso 0 dist 8.99731 4.64486 8.71286 9.56867 7.3094 5.74857 7.64822 5.72642 7.21418 7.88312 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 8.84146 16.2159 8.03035 13.052 4.99056 7.99857 21.9915 13.1741 7.61939 9.87172 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 8.84146 16.2159 8.03035 10.2589 3.78311 8.56342 13.7656 7.77116 4.91132 8.73993 numMergedOcc 0
11 mol 119 unq 2 iso 0 dist 8.84146 11.6573 7.6968 10.2589 3.78311 6.37542 13.7656 7.77116 6.08167 8.73993 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 6.93136 6.36527 5.73236 12.703 10.8441 8.41611 17.4764 13.4668 12.7056 5.99315 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.19078 6.79236 6.39031 13.1463 5.70788 8.35555 11.3742 8.28642 5.59336 5.87555 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 9.19078 6.79236 6.39031 13.1463 5.70788 8.35555 16.1858 13.1536 10.9728 8.87437 numMergedOcc 0
15 mol 156 unq 0 iso 0 dist 9.17868 7.59931 4.9941 14.4092 5.82636 7.73169 9.85133 6.2319 5.71107 8.34702 numMergedOcc 0
16 mol 156 unq 1 iso 0 dist 9.17868 7.59931 4.9941 14.4092 5.82636 7.73169 15.9362 9.97732 11.2067 9.06726 numMergedOcc 0
17 mol 156 unq 2 iso 0 dist 9.17868 7.59931 4.9941 14.4092 5.82636 7.73169 15.7471 10.5243 9.44399 8.33171 numMergedOcc 0
18 mol 156 unq 3 iso 0 dist 9.17868 17.1327 8.06913 14.4092 5.82636 5.38091 9.85133 6.2319 10.7023 8.34702 numMergedOcc 0
19 mol 156 unq 4 iso 0 dist 9.17868 17.1327 8.06913 14.4092 5.82636 5.38091 15.9362 9.97732 9.00862 9.06726 numMergedOcc 0
20 mol 156 unq 5 iso 0 dist 9.17868 17.1327 8.06913 14.4092 5.82636 5.38091 15.7471 10.5243 11.1271 8.33171 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 4.97005 10.0516 7.55358 15.3487 12.7155 7.20574 16.8906 15.9107 8.90184 7.54065 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 4.97005 10.0516 7.55358 11.0743 9.97575 6.85302 16.8906 15.9107 8.90184 8.87694 numMergedOcc 0
23 mol 186 unq 2 iso 0 dist 4.97005 10.0516 7.55358 11.0743 9.97575 6.85302 9.14781 8.64409 4.37002 9.09754 numMergedOcc 0
24 mol 186 unq 3 iso 0 dist 4.97005 5.57831 7.60991 11.0743 9.97575 9.98215 16.8906 15.9107 12.8303 8.87694 numMergedOcc 0
25 mol 186 unq 4 iso 0 dist 4.97005 5.57831 7.60991 11.0743 9.97575 9.98215 9.14781 8.64409 4.64235 9.09754 numMergedOcc 0
26 mol 186 unq 5 iso 0 dist 7.22 10.0516 8.87818 15.3487 11.2142 7.20574 16.8906 15.8402 8.90184 7.54065 numMergedOcc 0
27 mol 186 unq 6 iso 0 dist 7.22 10.0516 8.87818 11.0743 7.92653 6.85302 16.8906 15.8402 8.90184 8.87694 numMergedOcc 0
28 mol 186 unq 7 iso 0 dist 7.22 10.0516 8.87818 11.0743 7.92653 6.85302 9.14781 11.1051 4.37002 9.09754 numMergedOcc 0
29 mol 227 unq 0 iso 0 dist 9.33735 10.8608 9.56257 17.255 11.0628 8.03442 17.1087 12.9778 10.2525 9.34734 numMergedOcc 0
30 mol 227 unq 1 iso 0 dist 9.33735 10.8608 9.56257 17.255 11.0628 8.03442 15.9389 8.38865 10.5813 7.22101 numMergedOcc 0
31 mol 227 unq 2 iso 0 dist 9.33735 10.8608 9.56257 17.255 11.0628 8.03442 10.8811 5.4694 7.22396 8.65997 numMergedOcc 0
32 mol 227 unq 3 iso 0 dist 9.33735 10.8608 9.56257 17.255 11.0628 8.03442 16.2452 13.9676 6.10296 7.56888 numMergedOcc 0
33 mol 227 unq 4 iso 0 dist 9.33735 10.8608 9.56257 17.255 11.0628 8.03442 20.3593 16.9219 9.69537 7.55216 numMergedOcc 0
34 mol 294 unq 0 iso 0 dist 9.21767 5.62181 7.41079 11.4441 12.0308 9.13907 6.6414 12.1586 5.25615 8.15665 numMergedOcc 0
35 mol 294 unq 1 iso 0 dist 6.16375 10.0223 7.41079 17.2419 12.0308 9.13907 14.735 12.1586 5.25615 8.15665 numMergedOcc 0
